| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | Brc1ccc(cc1)C(CC(=O)O)NC(=O)c1nccc2[NH]ccc21 |
| InChI | InChI | 1.06 | InChI=1S/C17H14BrN3O3/c18-11-3-1-10(2-4-11)14(9-15(22)23)21-17(24)16-12-5-7-19-13(12)6-8-20-16/h1-8,14,19H,9H2,(H,21,24)(H,22,23)/t14-/m0/s1 |
| InChIKey | InChI | 1.06 | JDOCEJICJDECLA-AWEZNQCLSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)C[C@H](NC(=O)c1nccc2[nH]ccc12)c3ccc(Br)cc3 |
| SMILES | CACTVS | 3.385 | OC(=O)C[CH](NC(=O)c1nccc2[nH]ccc12)c3ccc(Br)cc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1cc(ccc1[C@H](CC(=O)O)NC(=O)c2c3cc[nH]c3ccn2)Br |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1cc(ccc1C(CC(=O)O)NC(=O)c2c3cc[nH]c3ccn2)Br |
